Dap

C₅H₇N₃ — CID 5918

About Dap

Dap (PubChem CID 5918) has the molecular formula C₅H₇N₃ and a molecular weight of 109.13 g/mol. Its IUPAC name is pyridine-3,4-diamine.

Molecular Properties

• Compound Name: Dap
• PubChem CID: 5918
• Molecular Formula: C₅H₇N₃
• Molecular Weight: 109.13 g/mol
• Exact Mass: 109.06
• IUPAC Name: pyridine-3,4-diamine
• SMILES: Nc1ccncc1N
• InChI: InChI=1S/C5H7N3/c6-4-1-2-8-3-5(4)7/h1-3H,7H2,(H2,6,8)
• InChIKey: OYTKINVCDFNREN-UHFFFAOYSA-N
• XLogP: 0.25
• TPSA: 64.93 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 3
• Heavy Atoms: 8
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	109.13
LogP ≤ 5	0.25
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of Dap?

The IUPAC name of Dap (CID 5918) is pyridine-3,4-diamine.

What is the SMILES notation for Dap?

The canonical SMILES for Dap is Nc1ccncc1N.

What is the InChIKey of Dap?

The InChIKey is OYTKINVCDFNREN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3/c6-4-1-2-8-3-5(4)7/h1-3H,7H2,(H2,6,8).

What are the key properties of Dap?

Dap has a molecular weight of 109.13 g/mol, XLogP of 0.25, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for Dap is sourced from PubChem (CID 5918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 5918 — identifiers, structure, computed properties (public domain)
• DrugCentral drug card 4336 — approved-drug record (CC BY-SA 4.0)

How this page is built: methodology · editorial policy & corrections.